Geometry & MOs

Info

ID:	288788
PubChem CID:	104325903
Reduced:	ClFON3C13H15 (1)
Stoich.:	ABCD3E13F15 (1)
Weight, g/mol:	257.142722
ΔH_f, kcal/mol:	-40.09
Dipole, Da:	3.39
IP(EA), eV:	-8.34(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-ethoxy-3-fluoro-N-[2-(2-methoxyethoxy)ethyl]aniline

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1)NCC2=NC=C(N2C)Cl)F

DOS

IR

Vibrations